Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetOxysterols receptor LXR-alpha
LigandBDBM50306083
Substrate/Competitorn/a
Meas. Tech.ChEMBL_605982 (CHEMBL1069926)
IC50 17±n/a nM
Citation Travins, JMBernotas, RCKaufman, DHQuinet, ENambi, PFeingold, IHuselton, CWilhelmsson, AGoos-Nilsson, AWrobel, J 1-(3-Aryloxyaryl)benzimidazole sulfones are liver X receptor agonists. Bioorg Med Chem Lett20:526-30 (2010) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Oxysterols receptor LXR-alpha
Name:Oxysterols receptor LXR-alpha
Synonyms:LXRA | Liver X Receptor alpha (LXR-alpha) | Liver X receptor alpha | Liver X receptor alpha (LXRA) | Liver X receptor alpha (NR1H3) | Liver X, LXR alpha | NR1H3 | NR1H3_HUMAN | Nuclear orphan receptor LXR-alpha | Nuclear receptor subfamily 1 group H member 3
Type:Enzyme Catalytic Domain
Mol. Mass.:50403.85
Organism:Homo sapiens (Human)
Description:Q13133
Residue:447
Sequence:
MSLWLGAPVPDIPPDSAVELWKPGAQDASSQAQGGSSCILREEARMPHSAGGTAGVGLEA
AEPTALLTRAEPPSEPTEIRPQKRKKGPAPKMLGNELCSVCGDKASGFHYNVLSCEGCKG
FFRRSVIKGAHYICHSGGHCPMDTYMRRKCQECRLRKCRQAGMREECVLSEEQIRLKKLK
RQEEEQAHATSLPPRASSPPQILPQLSPEQLGMIEKLVAAQQQCNRRSFSDRLRVTPWPM
APDPHSREARQQRFAHFTELAIVSVQEIVDFAKQLPGFLQLSREDQIALLKTSAIEVMLL
ETSRRYNPGSESITFLKDFSYNREDFAKAGLQVEFINPIFEFSRAMNELQLNDAEFALLI
AISIFSADRPNVQDQLQVERLQHTYVEALHAYVSIHHPHDRLMFPRMLMKLVSLRTLSSV
HSEQVFALRLQDKKLPPLLSEIWDVHE
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50306083
n/a
NameBDBM50306083
Synonyms:4-chloro-1-(2-chloro-5-(3-(trifluoromethylsulfonyl)phenoxy)phenyl)-2-methyl-1H-benzo[d]imidazole | CHEMBL605723
TypeSmall organic molecule
Emp. Form.C21H13Cl2F3N2O3S
Mol. Mass.501.306
SMILESCc1nc2c(Cl)cccc2n1-c1cc(Oc2cccc(c2)S(=O)(=O)C(F)(F)F)ccc1Cl |(40.06,-46.33,;38.52,-46.33,;37.61,-47.58,;36.15,-47.1,;34.82,-47.88,;34.82,-49.42,;33.48,-47.11,;33.49,-45.57,;34.81,-44.8,;36.15,-45.56,;37.61,-45.09,;37.6,-43.54,;38.93,-42.76,;38.92,-41.22,;40.25,-40.44,;41.58,-41.2,;41.59,-42.73,;42.93,-43.49,;44.26,-42.71,;44.24,-41.16,;42.9,-40.41,;45.56,-40.37,;46.64,-39.28,;44.46,-39.28,;46.88,-41.14,;48.22,-40.38,;46.88,-42.68,;48.37,-41.54,;37.57,-40.46,;36.24,-41.25,;36.26,-42.79,;34.94,-43.58,)|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: